Compound Identification
SMILES
ClC1=CC=C(C=C1)C1N(CCC2=C1C(=O)C1=CC=CC=C1C2=O)C(=O)C(Cl)(Cl)Cl
InChIKey
InChIKey=BAHSLHMMTUWKGZ-UHFFFAOYSA-N
Formula
C21H13Cl4NO3
Mass
469.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthoquinones
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthoquinones
Intermediate Tree Nodes
Not available
Direct Parent
Naphthoquinones
Alternative Parents
Isoquinoline quinones Isoquinolones and derivatives Quinones Aryl ketones Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Tertiary amines Amino acids and derivatives Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline quinone - Naphthoquinone - Isoquinolone - Aryl ketone - Quinone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkyl chloride - Amine - Hydrocarbon derivative - Alkyl halide - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthoquinones. These are compounds containing a naphthohydroquinone moiety, which consists of a benzene ring linearly fused to a bezene-1,4-dione (quinone).
External Descriptors
Not available